N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide

C18H18N2O4 — CID 2627260

IUPACN-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide
SMILESCC(=O)Nc1ccc(NC(=O)COc2cccc(C(C)=O)c2)cc1
InChIInChI=1S/C18H18N2O4/c1-12(21)14-4-3-5-17(10-14)24-11-18(23)20-16-8-6-15(7-9-16)19-13(2)22/h3-10H,11H2,1-2H3,(H,19,22)(H,20,23)
InChIKeyGCDDBGGNKDHTJT-UHFFFAOYSA-N
MW326.35 g/mol
LogP2.87
Rot. Bonds6

About N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide

N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide (PubChem CID 2627260) has the molecular formula C18H18N2O4 and a molecular weight of 326.35 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide
PubChem CID2627260
Molecular FormulaC18H18N2O4
Molecular Weight326.35 g/mol
Exact Mass326.13
IUPAC NameN-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide
SMILESCC(=O)Nc1ccc(NC(=O)COc2cccc(C(C)=O)c2)cc1
InChIInChI=1S/C18H18N2O4/c1-12(21)14-4-3-5-17(10-14)24-11-18(23)20-16-8-6-15(7-9-16)19-13(2)22/h3-10H,11H2,1-2H3,(H,19,22)(H,20,23)
InChIKeyGCDDBGGNKDHTJT-UHFFFAOYSA-N
XLogP2.87
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.35
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide (CID 2627260) is N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide is CC(=O)Nc1ccc(NC(=O)COc2cccc(C(C)=O)c2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide?
The InChIKey is GCDDBGGNKDHTJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O4/c1-12(21)14-4-3-5-17(10-14)24-11-18(23)20-16-8-6-15(7-9-16)19-13(2)22/h3-10H,11H2,1-2H3,(H,19,22)(H,20,23).
What are the key properties of N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide?
N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide has a molecular weight of 326.35 g/mol, XLogP of 2.87, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide is sourced from PubChem (CID 2627260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).